BDBM50183712 CHEMBL425415::N-(1-benzyl-4-(2-(hydroxyamino)-2-oxoethyl)piperidin-4-yl)-4-((2-methylquinolin-4-yl)methoxy)benzamide

SMILES: Cc1cc(COc2ccc(cc2)C(=O)NC2(CC(=O)NO)CCN(Cc3ccccc3)CC2)c2ccccc2n1

InChI Key: InChIKey=PACKAWWLZSBYDP-UHFFFAOYSA-N

Data: 4 KI  2 IC50

Find this compound or compounds like it in BindingDB or PDB:

Substructure Similarity at least:  must be >=0.5 Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 6 hits for monomerid = 50183712   

Target/Host (Institution)	Ligand	Target/Host Links	Ligand Links	Trg + Lig Links	Ki nM	ΔG° kcal/mole	IC50 nM	Kd nM	EC50/IC50 nM	koff s-1	kon M-1s-1	pH	Temp °C
Matrix metalloproteinase-9 (Homo sapiens (Human))	BDBM50183712 (CHEMBL425415 | N-(1-benzyl-4-(2-(hydroxyamino)-2-o...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NC2(CC(=O)NO)CCN(Cc3ccccc3)CC2)c2ccccc2n1 Show InChI InChI=1S/C32H34N4O4/c1-23-19-26(28-9-5-6-10-29(28)33-23)22-40-27-13-11-25(12-14-27)31(38)34-32(20-30(37)35-39)15-17-36(18-16-32)21-24-7-3-2-4-8-24/h2-14,19,39H,15-18,20-22H2,1H3,(H,34,38)(H,35,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>2.13E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity to MMP9				Bioorg Med Chem Lett 16: 2699-704 (2006) Article DOI: 10.1016/j.bmcl.2006.02.015 BindingDB Entry DOI: 10.7270/Q2TB16H3
					More data for this Ligand-Target Pair
72 kDa type IV collagenase (Homo sapiens (Human))	BDBM50183712 (CHEMBL425415 | N-(1-benzyl-4-(2-(hydroxyamino)-2-o...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NC2(CC(=O)NO)CCN(Cc3ccccc3)CC2)c2ccccc2n1 Show InChI InChI=1S/C32H34N4O4/c1-23-19-26(28-9-5-6-10-29(28)33-23)22-40-27-13-11-25(12-14-27)31(38)34-32(20-30(37)35-39)15-17-36(18-16-32)21-24-7-3-2-4-8-24/h2-14,19,39H,15-18,20-22H2,1H3,(H,34,38)(H,35,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>3.33E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity to MMP2				Bioorg Med Chem Lett 16: 2699-704 (2006) Article DOI: 10.1016/j.bmcl.2006.02.015 BindingDB Entry DOI: 10.7270/Q2TB16H3
					More data for this Ligand-Target Pair
Interstitial collagenase (Homo sapiens (Human))	BDBM50183712 (CHEMBL425415 | N-(1-benzyl-4-(2-(hydroxyamino)-2-o...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NC2(CC(=O)NO)CCN(Cc3ccccc3)CC2)c2ccccc2n1 Show InChI InChI=1S/C32H34N4O4/c1-23-19-26(28-9-5-6-10-29(28)33-23)22-40-27-13-11-25(12-14-27)31(38)34-32(20-30(37)35-39)15-17-36(18-16-32)21-24-7-3-2-4-8-24/h2-14,19,39H,15-18,20-22H2,1H3,(H,34,38)(H,35,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>4.95E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity to MMP1				Bioorg Med Chem Lett 16: 2699-704 (2006) Article DOI: 10.1016/j.bmcl.2006.02.015 BindingDB Entry DOI: 10.7270/Q2TB16H3
					More data for this Ligand-Target Pair
Collagenase 3 (Homo sapiens (Human))	BDBM50183712 (CHEMBL425415 | N-(1-benzyl-4-(2-(hydroxyamino)-2-o...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NC2(CC(=O)NO)CCN(Cc3ccccc3)CC2)c2ccccc2n1 Show InChI InChI=1S/C32H34N4O4/c1-23-19-26(28-9-5-6-10-29(28)33-23)22-40-27-13-11-25(12-14-27)31(38)34-32(20-30(37)35-39)15-17-36(18-16-32)21-24-7-3-2-4-8-24/h2-14,19,39H,15-18,20-22H2,1H3,(H,34,38)(H,35,37)	PDB MMDB NCI pathway Reactome pathway KEGG UniProtKB/SwissProt B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	>5.03E+3	n/a	n/a	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Binding affinity to MMP13				Bioorg Med Chem Lett 16: 2699-704 (2006) Article DOI: 10.1016/j.bmcl.2006.02.015 BindingDB Entry DOI: 10.7270/Q2TB16H3
					More data for this Ligand-Target Pair
Disintegrin and metalloproteinase domain-containing protein 17 (Homo sapiens (Human))	BDBM50183712 (CHEMBL425415 | N-(1-benzyl-4-(2-(hydroxyamino)-2-o...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NC2(CC(=O)NO)CCN(Cc3ccccc3)CC2)c2ccccc2n1 Show InChI InChI=1S/C32H34N4O4/c1-23-19-26(28-9-5-6-10-29(28)33-23)22-40-27-13-11-25(12-14-27)31(38)34-32(20-30(37)35-39)15-17-36(18-16-32)21-24-7-3-2-4-8-24/h2-14,19,39H,15-18,20-22H2,1H3,(H,34,38)(H,35,37)	PDB MMDB Reactome pathway KEGG UniProtKB/SwissProt UniProtKB/TrEMBL B.MOAD DrugBank antibodypedia GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	290	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of LPS-stimulated TNFalpha production in human whole blood				Bioorg Med Chem Lett 16: 2699-704 (2006) Article DOI: 10.1016/j.bmcl.2006.02.015 BindingDB Entry DOI: 10.7270/Q2TB16H3
					More data for this Ligand-Target Pair
ADAM17 (Sus scrofa (pig))	BDBM50183712 (CHEMBL425415 | N-(1-benzyl-4-(2-(hydroxyamino)-2-o...) Show SMILES Cc1cc(COc2ccc(cc2)C(=O)NC2(CC(=O)NO)CCN(Cc3ccccc3)CC2)c2ccccc2n1 Show InChI InChI=1S/C32H34N4O4/c1-23-19-26(28-9-5-6-10-29(28)33-23)22-40-27-13-11-25(12-14-27)31(38)34-32(20-30(37)35-39)15-17-36(18-16-32)21-24-7-3-2-4-8-24/h2-14,19,39H,15-18,20-22H2,1H3,(H,34,38)(H,35,37)	PDB MMDB UniProtKB/SwissProt B.MOAD GoogleScholar AffyNet	CHEMBL PC cid PC sid UniChem Similars	Article PubMed	n/a	n/a	1.80	n/a	n/a	n/a	n/a	n/a	n/a
Bristol-Myers Squibb Pharmaceutical Research Institute Curated by ChEMBL					Assay Description Inhibition of porcine TACE				Bioorg Med Chem Lett 16: 2699-704 (2006) Article DOI: 10.1016/j.bmcl.2006.02.015 BindingDB Entry DOI: 10.7270/Q2TB16H3
					More data for this Ligand-Target Pair